Geometry & MOs

Info

ID:	414602
PubChem CID:	135087561
Reduced:	NSO4C21H23 (1)
Stoich.:	ABC4D21E23 (1)
Weight, g/mol:	313.109627
ΔH_f, kcal/mol:	-116.66
Dipole, Da:	5.1
IP(EA), eV:	-8.65(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1COC2(CCN(CC2)C(=O)CCC3=CC4=C(C=C3)OCO4)C5=C1SC=C5

DOS

IR

Vibrations